N-[(Z)-(2,6-difluorophenyl)methylideneamino]-2-(2-fluoroanilino)acetamide
Formula:C15H12N3OF3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2,6-difluorophenyl)methylideneamino]-2-(2-fluoroanilino)acetamide is a drug-like molecule.
| MolName | N-[(Z)-(2,6-difluorophenyl)methylideneamino]-2-(2-fluoroanilino)acetamide |
| MolecularFormula | C15H12N3OF3 |
| Smiles | O=C(CNc(cccc1)c1F)N/N=C\c(c(F)ccc1)c1F |
| InChI | InChI=1S/C15H12F3N3O/c16-11-5-3-6-12(17)10(11)8-20-21-15(22)9-19-14-7-2-1-4-13(14)18/h1-8,19H,9H2,(H,21,22) |
| InChIK | XPZYSJRKRAWTKH-UHFFFAOYSA-N |
| TotalMolweight | 307.274 |
| Molweight | 307.274 |
| MonoisotopicMass | 307.093246 |
| CLogP | 2.7959 |
| CLogS | -4.485 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 231.26 |
| Relative PSA | 0.20527 |
| PolarSurfaceArea | 53.49 |
| Druglikeness | 3.6901 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.63636 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 3 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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